0 B9R1.35 CC(=O)C1=CN=C(N)O1 BB57-6487 [0,0,0,0,0,0|3,1,0]=4 1 B9R1.35 CC(=O)C1=CSC(C)=N1 BB55-8336 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 CC(=O)C1=CSC(N)=N1 BB57-4573 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=O)C1=NC(C)=CN1 BB57-7193 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.35 CC(N)C1=CC=C(Br)S1 BB55-0008 [0,0,0,0,0,0|2,1,1]=4 5 B9R1.35 CC(N)C1=CC=C(Cl)S1 BB55-0009 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.35 CC1=CC(C(=O)Cl)=CS1 BB55-5691 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.35 CC1=CC(C(=O)O)=CS1 BB55-0634 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 CC1=CC=C(C(=N)N)O1 BB12-3708 [0,0,0,0,0,0|3,1,0]=4 9 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BB55-5571 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.35 CC1=CC=C(C(N)=S)S1 BB50-0406 [0,0,0,0,0,0|2,1,0]=3 11 B9R1.35 CC1=CN=C(C(=O)[O-])S1 BB55-8350 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.35 CC1=CNC(C(=O)O)=N1 BB12-3671 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.35 CC1=CSC(C(=O)[O-])=N1 BB55-4757 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.35 CC1=NC(C(=O)Cl)=CO1 BB58-1914 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 CC1=NC(C(=O)O)=CS1 BB01-2835 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.35 CC1=NC(C(=O)O)=NN1 BB54-5129 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.35 CC1=NC=C(C(=O)O)N1 BB90-0104 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.35 CC1=NC=C(C(=O)O)S1 BB57-5871 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.35 CC1=NOC(C(=O)O)=C1 BB05-2690 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.35 CC1=NOC(C(=O)O)=C1 BB54-1988 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.35 CN1C=C(C(=O)O)C=N1 BB54-3240 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 CN1C=CC(C(=O)Cl)=N1 BB05-0928 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.35 CN1C=CC(C(=O)Cl)=N1 BB55-4536 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.35 CN1C=CC(C(=O)O)=N1 BB54-1623 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.35 CN1C=CC(C(N)=O)=N1 BB05-4815 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.35 CN1C=CC(C(N)=O)=N1 BB58-2005 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.35 CN1C=NC(C(=O)O)=C1 BB54-2031 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.35 CN1C=NC(C(=O)O)=N1 BB58-4987 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.35 NC(=O)C1=CC(Br)=CS1 BB57-1176 [0,0,0,0,0,0|3,1,0]=4 30 B9R1.35 NC(=O)C1=CC=C(Br)O1 BB55-4785 [0,0,0,0,0,0|1,2,0]=3 31 B9R1.35 NC(=O)C1=CC=C(Br)S1 BB55-4786 [0,0,0,0,0,0|1,1,0]=2 32 B9R1.35 NC1=CC(C(=O)O)=NN1 BB55-3807 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.35 NC1=NC(C(=O)O)=CS1 BB55-6527 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.35 NC1=NC=C(C(=O)O)S1 BB57-4014 [0,0,0,0,0,0|2,0,0]=2 35 B9R1.35 NC1=NN=C(C(=O)O)O1 BB57-2153 [0,0,0,0,0,0|3,1,0]=4 36 B9R1.35 NC1=NNC(C(=O)O)=C1 BB05-1116 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.35 NC1=NNC(C(=O)O)=N1 BB53-2042 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.35 O=C(Cl)C1=CC(Br)=CS1 BB55-5706 [0,0,0,0,0,0|3,1,0]=4 39 B9R1.35 O=C(Cl)C1=CC=C(Br)S1 BB55-5569 [0,0,0,0,0,0|1,1,0]=2 40 B9R1.35 O=C(O)C1=CC(Br)=CS1 BB05-1234 [0,0,0,0,0,0|2,1,0]=3 41 B9R1.35 O=C(O)C1=CC(Br)=CS1 BB55-0644 [0,0,0,0,0,0|2,1,0]=3 42 B9R1.35 O=C(O)C1=CC(Cl)=NO1 BB54-5230 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.35 O=C(O)C1=CSC(Br)=N1 BB58-0325 [0,0,0,0,0,0|2,1,0]=3 44 B9R1.35 O=C(O)C1=NC(Cl)=NN1 BB53-2032 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.35 O=C(O)C1=NNC(Br)=N1 BB55-8866 [0,0,0,0,0,0|3,1,0]=4 46 B9R1.35 O=C(O)C1=NNC(Cl)=N1 BB55-8865 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.35 O=C(O)C1=NNC(O)=N1 BB54-1874 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.35 O=C1N=C(C(=O)O)NN1 BB54-3676 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.35 O=C1NC=C(C(=O)O)N1 BB26-0164 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.35 O=C1NC=C(C(=O)O)N1 BB58-0110 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.35 O=C1NN=C(C(=O)O)N1 BB12-3315 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.35 O=[N+]([O-])C1=CNC(Cl)=N1 BB12-1878 [0,0,0,0,0,0|3,0,1]=4 53 B8R1.1 CC1=CC=C(CCl)S1 BB58-3265 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.1 CC1=CC=C(CN)S1 BB55-8315 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.1 CC1=CC=C(CO)S1 BB90-0120 [1,0,0,0,0,0|1,0,1]=3 56 B8R1.1 CC1=CN=C(C=O)S1 BB55-8345 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.1 CC1=CN=C(CO)S1 BB58-0481 [1,0,0,0,0,0|2,0,1]=4 58 B8R1.1 CC1=CNC(C=O)=N1 BB57-1115 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.1 CC1=NC=C(C=O)S1 BB54-4113 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.1 CN1C=CC(C=O)=N1 BB05-1117 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.1 NC1=NC=C(C=O)S1 BB57-0379 [1,0,0,0,0,0|2,0,0]=3 62 B8R1.1 NC1=NC=C(CO)S1 BB57-4003 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.1 NCC1=CC=C(Br)S1 BB58-0508 [1,0,0,0,0,0|1,1,1]=4 64 B8R1.1 O=CC1=CC=C(Cl)S1 BB05-2319 [1,0,0,0,0,0|0,0,0]=1 65 B8R1.1 O=CC1=CN=C(Cl)S1 BB55-8396 [1,0,0,0,0,0|1,0,0]=2 66 B8R1.1 O=CC1=CSC(Br)=C1 BB58-0528 [1,0,0,0,0,0|2,1,0]=4 67 B8R1.1 OCC1=CC=C(Br)O1 BB90-0114 [1,0,0,0,0,0|0,2,1]=4 68 B8R1.7 CC(=O)C1=NC=CN1 BB58-3749 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.7 NC(=O)C1=NNC=C1 BB05-4560 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.7 O=C(Cl)C1=CC=NN1 BB58-3477 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.7 O=C(O)C1=CN=CS1 BB55-7267 [1,0,0,0,0,0|1,0,0]=2 72 B8R1.7 O=C(O)C1=CN=NN1 BB90-0079 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.7 O=C(O)C1=CN=S=N1 BB54-5267 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.7 O=C(O)C1=CNN=C1 BB01-4399 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.7 O=C(O)C1=CNN=C1 BB05-1411 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.7 O=C(O)C1=NNC=N1 BB54-0770 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.7 O=C(O)C1=NOC=C1 BB20-4533 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.7 O=C(O)[C@H]1C=CCN1 BB32-2958 [1,0,0,0,0,0|1,0,2]=4 79 B8R1.7 O=C([O-])C1=NC=CS1 BB54-4045 [1,0,0,0,0,0|1,0,1]=3 80 B8R1.7 OB(O)C1=CC=CO1 BB56-0777 [1,0,0,0,0,0|1,1,1]=4 81 B10R1.14 CC1=CC=C(C(=O)NN)O1 BB58-0339 [0,1,0,0,0,0|2,1,0]=4 82 B10R1.14 CC1=CC=C(C(=O)NN)S1 BB55-2159 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.14 CC1=CC=C(\C(N)=N/O)O1 BB12-3494 [0,1,0,0,0,0|2,1,0]=4 84 B10R1.14 CCC(=O)C1=CC=C(C)S1 BB55-2281 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.14 CCC(N)C1=CC=C(Cl)S1 BB55-1698 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.14 COC(=O)C1=CC(N)=CS1 BB58-1694 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.14 COC(=O)C1=CC=C(N)S1 BB54-5468 [0,1,0,0,0,0|1,0,0]=2 88 B10R1.14 COC(=O)C1=CN=C(C)S1 BB57-5869 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.14 COC(=O)C1=CSC(C)=C1 BB57-2095 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.14 COC(=O)C1=NC(Cl)=NN1 BB55-7518 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.14 NNC(=O)C1=CC=C(Br)S1 BB55-2157 [0,1,0,0,0,0|1,1,0]=3 92 B10R1.14 NNC(=O)C1=CC=C(Cl)S1 BB55-2158 [0,1,0,0,0,0|1,0,0]=2 93 B10R1.14 O=C(NO)C1=NC(Cl)=NN1 BB55-8877 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.31 CC(=O)C1=CC(CCl)=CS1 BB54-5393 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.31 CCC1=CC(C(=O)O)=CS1 BB55-0637 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.31 CCC1=CC=C(C(=O)Cl)S1 BB55-5709 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.31 CCC1=CC=C(C(=O)O)S1 BB05-0002 [0,1,0,0,0,0|1,0,0]=2 98 B10R1.31 CCC1=CC=C(C(=O)O)S1 BB55-0647 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.31 CCC1=NC(C(=O)O)=CN1 BB90-0132 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.31 CCC1=NC(C(=O)O)=CO1 BB12-3563 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.31 CCC1=NC(C(=O)O)=CS1 BB12-3311 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.31 CCN1C=CC(C(=O)O)=N1 BB01-4866 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.31 COC1=NC=C(C(=O)[O-])S1 BB58-3686 [0,1,0,0,0,0|2,0,1]=4 104 B10R1.31 NCC1=CC=C(C(=O)O)O1 BB58-1060 [0,1,0,0,0,0|1,1,0]=3 105 B10R1.31 O=C(O)C1=CC=C(CO)O1 BB55-3457 [0,1,0,0,0,0|1,1,0]=3 106 B10R1.31 O=C(O)C1=NN(CO)C=C1 BB05-1993 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.31 O=C(O)C1=NN(CO)C=C1 BB57-3439 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.55 CC1=CC=C(S(=O)(=O)Cl)S1 BB12-3381 [0,1,0,0,0,0|2,0,1]=4 109 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 BB54-4199 [0,1,0,0,0,0|1,0,0]=2 110 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 BB57-2093 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.58 CN1N=C(C(=O)O)N=C1Cl BB58-5138 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.59 CC1=C(C(=O)O)N=C(Br)N1 BB26-0239 [0,1,0,0,0,0|2,1,0]=4 113 B10R1.59 CC1=C(C(=O)O)N=C(Br)S1 BB26-0182 [0,1,0,0,0,0|2,1,0]=4 114 B10R1.59 CC1=C(C(=O)O)N=C(Cl)S1 BB26-0154 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.59 CC1=C(C(=O)O)N=C(N)S1 BB12-3541 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.59 CC1=C(C(=O)O)SC(=O)N1 BB58-1029 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.59 CC1=CC(C(=O)O)=C(N)S1 BB57-2094 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.59 CC1=CN(C)C(C(=O)O)=N1 BB58-4992 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.59 CC1=NC(C(=O)O)=C(C)S1 BB55-8559 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.59 CC1=NC(C)=C(C(=O)O)N1 BB58-2036 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.59 CN1C=C(Br)C(C(=O)O)=N1 BB55-3495 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.59 CN1C=C(Cl)C(C(=O)O)=N1 BB12-1896 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.59 CN1C=C(I)C(C(=O)O)=N1 BB05-0009 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.59 CN1C=C(I)C(C(=O)O)=N1 BB55-3500 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.59 CN1C=C(N)C(C(=O)O)=N1 BB05-1517 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.59 CN1N=C(Cl)N=C1C(=O)O BB58-3069 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.194 CC1=C(C(=O)O)C=CN1C BB57-3411 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 BB55-0635 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.194 CC1=CN=C(C(=O)O)N1C BB58-5002 [0,1,0,0,0,0|3,0,0]=4 130 B8R0.23 C=C(NC(C)=O)C(=O)O BB01-7568 [0,0,1,0,0,0|2,0,1]=4 131 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [0,0,0,0,0,1|2,1,0]=4 132 B10R1.13 NC(=O)C1=CC=C(N)N=C1 BB57-6415 [0,0,0,0,0,1|3,0,0]=4 133 B10R1.13 NC(=O)C1=CC=C(N)N=N1 BB01-7655 [0,0,0,0,0,1|3,0,0]=4 134 B10R1.13 NC(=O)C1=NNC(=O)C=C1 BB10-0123 [0,0,0,0,0,1|3,0,0]=4 135 B10R1.13 NC1=CC=C(S(=O)O)C=C1 BB57-6605 [0,0,0,0,0,1|3,0,0]=4 136 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [0,0,0,0,0,1|2,0,0]=3 137 B10R1.13 O=C(Cl)C1=NN=C(Cl)C=C1 BB10-0141 [0,0,0,0,0,1|2,0,0]=3 138 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 BB55-6488 [0,0,0,0,0,1|1,0,0]=2 139 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [0,0,0,0,0,1|2,0,0]=3 140 B10R1.13 O=C(O)C1=NC=C(F)C=N1 BB31-1339 [0,0,0,0,0,1|2,1,0]=4 141 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [0,0,0,0,0,1|1,1,0]=3 142 B10R1.13 O=C1C=CC(C(=O)O)=NN1 BB12-2030 [0,0,0,0,0,1|2,0,0]=3 143 B10R1.54 CC1=CC=C(CC(=O)O)S1 BB56-0024 [0,0,0,0,0,1|1,0,0]=2 144 B10R1.54 CC1=NN(CC(=O)O)C=C1 BB55-3471 [0,0,0,0,0,1|3,0,0]=4 145 B10R1.54 CN1C=CC(CC(=O)O)=N1 BB05-4664 [0,0,0,0,0,1|3,0,0]=4 146 B10R1.54 NC1=NN(CC(=O)O)C=C1 BB05-1911 [0,0,0,0,0,1|3,0,0]=4 147 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 BB56-1329 [0,0,0,0,0,1|0,0,0]=1 148 B10R1.54 O=C(O)CN1C=C(Cl)C=N1 BB05-1949 [0,0,0,0,0,1|3,0,0]=4 149 B10R1.113 N=C(N)C1=CC(Cl)=CC=C1 BB01-7872 [0,0,0,0,0,1|3,0,0]=4 150 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 BB20-4612 [0,0,0,0,0,1|2,0,0]=3 151 B10R1.113 NC1=CC(C(=O)O)=NC=C1 BB54-4685 [0,0,0,0,0,1|2,0,0]=3 152 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB17-0499 [0,0,0,0,0,1|1,1,0]=3 153 B10R1.113 O=C(O)C1=CC(O)=CN=C1 BB01-2808 [0,0,0,0,0,1|2,0,0]=3 154 B7R0.4 C=CCSCC(=O)O BB12-3265 [1,0,1,0,0,0|0,0,2]=4 155 B7R1.1 O=CC1=CN=CS1 BB55-8342 [2,0,0,0,0,0|1,0,0]=3 156 B7R1.1 O=CC1=CSC=N1 BB57-0141 [2,0,0,0,0,0|2,0,0]=4 157 B7R1.2 CC1=CC=C(N)S1 BB55-4553 [2,0,0,0,0,0|1,0,1]=4 158 B9R1.7 O\N=C\C1=CC=C(Br)S1 BB01-7080 [1,1,0,0,0,0|0,1,0]=3 159 B9R1.21 COC1=NC=C(C=O)S1 BB55-8397 [1,1,0,0,0,0|2,0,0]=4 160 B9R1.21 O=CC1=CC(CCl)=CS1 BB54-5392 [1,1,0,0,0,0|2,0,0]=4 161 B9R1.23 CC1=C(Br)C=C(C=O)S1 BB05-0499 [1,1,0,0,0,0|1,0,0]=3 162 B9R1.23 O=CC1=CC(Br)=C(Br)O1 BB17-1111 [1,1,0,0,0,0|0,2,0]=4 163 B9R1.23 O=CC1=CC(Br)=C(Br)S1 BB05-0991 [1,1,0,0,0,0|0,1,0]=3 164 B9R1.11 CCC(=O)C1=NC=CS1 BB55-8398 [1,1,0,0,0,0|2,0,0]=4 165 B9R1.11 COC(=O)C1=CC=CN1 BB54-1949 [1,1,0,0,0,0|1,0,0]=3 166 B9R1.11 COC(=O)C1=CC=NO1 BB05-4453 [1,1,0,0,0,0|1,1,0]=4 167 B9R1.11 COC(=O)C1=CC=NO1 BB54-4360 [1,1,0,0,0,0|1,1,0]=4 168 B9R1.11 COC(=O)C1=CNC=N1 BB20-4625 [1,1,0,0,0,0|2,0,0]=4 169 B9R1.11 COC(=O)C1=NNC=C1 BB12-1846 [1,1,0,0,0,0|2,0,0]=4 170 B9R1.11 C\C(=N/O)C1=CC=CO1 BB05-0882 [1,1,0,0,0,0|1,1,0]=4 171 B9R1.11 C\C(=N\O)C1=CC=CO1 BB01-6608 [1,1,0,0,0,0|1,1,0]=4 172 B9R1.11 C\C(=N\O)C1=CC=CS1 BB01-6607 [1,1,0,0,0,0|1,0,0]=3 173 B9R1.11 NNC(=O)C1=CC=CN1 BB01-6450 [1,1,0,0,0,0|2,0,0]=4 174 B9R1.11 NNC(=O)C1=CC=CO1 BB01-6372 [1,1,0,0,0,0|1,1,0]=4 175 B9R1.41 CC(=O)C1=C(C)N=CS1 BB57-3729 [1,1,0,0,0,0|2,0,0]=4 176 B9R1.41 CC1=C(C(=O)O)C=CN1 BB57-2151 [1,1,0,0,0,0|2,0,0]=4 177 B9R1.41 CC1=C(C(=O)O)N=CN1 BB12-2055 [1,1,0,0,0,0|2,0,0]=4 178 B9R1.41 CC1=C(C(=O)O)N=CO1 BB57-4109 [1,1,0,0,0,0|2,0,0]=4 179 B9R1.41 CC1=C(C(=O)O)N=CS1 BB26-0189 [1,1,0,0,0,0|2,0,0]=4 180 B9R1.41 CC1=C(C(=O)O)N=CS1 BB58-0096 [1,1,0,0,0,0|2,0,0]=4 181 B9R1.41 CC1=C(C(=O)O)NC=N1 BB12-3121 [1,1,0,0,0,0|2,0,0]=4 182 B9R1.41 CC1=C(C(=O)O)SC=N1 BB12-3519 [1,1,0,0,0,0|1,0,0]=3 183 B9R1.41 NC1=C(C(=O)O)NN=C1 BB55-4193 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.41 NC1=C(C(=O)O)SC=C1 BB53-1404 [1,1,0,0,0,0|0,0,0]=2 185 B9R1.41 NC1=CNN=C1C(=O)O BB05-3792 [1,1,0,0,0,0|2,0,0]=4 186 B9R1.41 NC1=CNN=C1C(=O)O BB54-4948 [1,1,0,0,0,0|2,0,0]=4 187 B9R1.41 NC1=CSN=C1C(=O)O BB57-0568 [1,1,0,0,0,0|2,0,0]=4 188 B9R1.41 O=C(O)C1=C(Br)C=NN1 BB55-3823 [1,1,0,0,0,0|2,0,0]=4 189 B9R1.41 O=C(O)C1=C(Cl)C=NN1 BB56-2893 [1,1,0,0,0,0|2,0,0]=4 190 B9R1.41 O=C(O)C1=C(I)C=NN1 BB55-3048 [1,1,0,0,0,0|2,0,0]=4 191 B9R1.41 O=C(O)C1=NNC=C1Br BB05-0862 [1,1,0,0,0,0|2,0,0]=4 192 B9R1.41 O=C(O)C1=NNC=C1Br BB54-1515 [1,1,0,0,0,0|2,0,0]=4 193 B9R1.41 O=C(O)C1=NNC=C1Cl BB05-0005 [1,1,0,0,0,0|2,0,0]=4 194 B9R1.41 O=C(O)C1=NNC=C1I BB05-0857 [1,1,0,0,0,0|2,0,0]=4 195 B9R1.41 O=[N+]([O-])C1=C(Br)C=CS1 BB20-4586 [1,1,0,0,0,0|1,0,1]=4 196 B11R1.3 COC1=NC=C(C(=O)O)C=C1 BB54-0843 [0,1,0,0,0,1|2,0,0]=4 197 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 BB53-1358 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 BB12-3514 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 BB58-0453 [0,1,0,0,0,1|1,1,0]=4 201 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [0,1,0,0,0,1|1,1,0]=4 202 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [0,1,0,0,0,1|2,0,0]=4 203 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 BB57-0237 [0,1,0,0,0,1|1,0,0]=3 204 B11R1.22 COC(=O)C1=CC=C(O)C=N1 BB56-2624 [0,1,0,0,0,1|2,0,0]=4 205 B11R1.22 COC(=O)C1=NC=C(N)C=C1 BB31-1465 [0,1,0,0,0,1|2,0,0]=4 206 B11R1.22 COC(=O)C1=NNC(=O)C=C1 BB10-0119 [0,1,0,0,0,1|2,0,0]=4 207 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB26-0169 [0,1,0,0,0,1|2,0,0]=4 208 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 BB53-4155 [0,1,0,0,0,1|2,0,0]=4 209 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 BB01-6260 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 BB57-1814 [0,1,0,0,0,1|2,0,0]=4 211 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB17-0728 [0,1,0,0,0,1|2,0,0]=4 212 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 BB20-4599 [0,1,0,0,0,1|1,1,0]=4 213 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 BB12-2552 [0,1,0,0,0,1|1,0,0]=3 214 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 BB12-2178 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl BB12-2212 [0,1,0,0,0,1|1,0,0]=3 216 B11R1.39 COC(=O)CC1=CN=C(N)S1 BB54-5402 [0,1,0,0,0,1|2,0,0]=4 217 B11R1.314 CC1=CC=C(C(N)C(=O)O)S1 BB31-8491 [0,1,0,0,0,1|1,0,0]=3 218 B11R1.23 CNC(=O)C1=CC=NC(Cl)=C1 BB12-3222 [0,1,0,0,0,1|2,0,0]=4 219 B11R1.23 CNC(=O)C1=NC(Cl)=CC=C1 BB57-3764 [0,1,0,0,0,1|2,0,0]=4 220 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 BB01-2813 [0,1,0,0,0,1|1,1,0]=4 221 B11R1.23 COC(=O)C1=NC=CC(O)=C1 BB32-2632 [0,1,0,0,0,1|2,0,0]=4 222 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 BB57-3753 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.23 N\C(=N/O)C1=CC(Cl)=NC=C1 BB12-3492 [0,1,0,0,0,1|2,0,0]=4 224 B11R1.74 CC1=CC(=O)C=C(C(=O)O)N1 BB57-2517 [0,1,0,0,0,1|2,0,0]=4 225 B11R1.74 CC1=CC(=O)C=C(C(=O)O)O1 BB57-2516 [0,1,0,0,0,1|1,1,0]=4 226 B11R1.74 CC1=NC(O)=NC(C(=O)O)=C1 BB01-7742 [0,1,0,0,0,1|2,0,0]=4 227 B11R1.74 N=C1NC(=O)C=C(C(=O)O)S1 BB01-3293 [0,1,0,0,0,1|1,0,0]=3 228 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 BB10-1202 [0,1,0,0,0,1|2,0,0]=4 229 B11R1.74 O=C1C=C(C(=O)O)NC(=S)N1 BB54-1700 [0,1,0,0,0,1|2,0,0]=4 230 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 BB54-0431 [0,1,0,0,0,1|2,0,0]=4 231 B11R1.159 NC1=CC=CC(C(=O)O)=C1N BB54-3084 [0,1,0,0,0,1|2,0,0]=4 232 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [0,1,0,0,0,1|1,1,0]=4 233 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [0,1,0,0,0,1|1,0,0]=3 234 B11R1.167 NC(=O)C1=NC(Cl)=CNC1=O BB31-4364 [0,1,0,0,0,1|2,0,0]=4 235 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=N1 BB31-8301 [0,1,0,0,0,1|1,1,0]=4 236 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 BB12-2280 [0,1,0,0,0,1|2,0,0]=4 237 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 BB05-1921 [0,1,0,0,0,1|1,1,0]=4 238 B11R1.266 O=C(O)C1=CC(CO)=CC=C1 BB57-2446 [0,1,0,0,0,1|2,0,0]=4 239 B11R1.15 CCOC(=O)C1=CN=C(N)S1 BB55-6567 [0,2,0,0,0,0|2,0,0]=4 240 B11R1.44 CCC1=CC=C(C(=O)NN)S1 BB55-2108 [0,2,0,0,0,0|2,0,0]=4 241 B11R1.44 CNC(=O)C1=CC=C(CCl)O1 BB12-3390 [0,2,0,0,0,0|1,1,0]=4 242 B11R1.44 COC(=O)C1=CC(CCl)=CS1 BB55-3421 [0,2,0,0,0,0|2,0,0]=4 243 B11R1.44 COC(=O)C1=CC=C(CBr)S1 BB05-3969 [0,2,0,0,0,0|0,1,0]=3 244 B11R1.44 COC(=O)C1=CC=C(CBr)S1 BB54-4338 [0,2,0,0,0,0|0,1,0]=3 245 B11R1.44 COC(=O)C1=CC=C(CCl)O1 BB12-3464 [0,2,0,0,0,0|0,1,0]=3 246 B11R1.44 COC(=O)C1=CC=C(CN)O1 BB58-1058 [0,2,0,0,0,0|1,1,0]=4 247 B11R1.44 COC(=O)C1=CC=C(CO)O1 BB55-3456 [0,2,0,0,0,0|1,1,0]=4 248 B11R1.44 COC(=O)C1=NN(CCl)C=C1 BB57-1225 [0,2,0,0,0,0|2,0,0]=4 249 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 BB05-0106 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 BB55-0099 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.225 COC(=O)C1=C(N)C=C(C)N1 BB11-0019 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.226 COC(=O)C1=CC(C)=C(C)O1 BB57-4958 [0,2,0,0,0,0|1,1,0]=4 253 B11R1.48 CCC1=C(Br)C=C(C(=O)Cl)S1 BB55-5707 [0,2,0,0,0,0|2,0,0]=4 254 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 BB05-1236 [0,2,0,0,0,0|1,0,0]=3 255 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 BB55-0645 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.124 CCCC1=CC=C(C(=O)O)S1 BB05-2200 [0,2,0,0,0,0|1,0,0]=3 257 B11R1.124 CNCC1=CC=C(C(=O)O)S1 BB58-3645 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.124 COCC1=CC=C(C(=O)O)O1 BB53-1836 [0,2,0,0,0,0|1,1,0]=4 259 B11R1.124 COCC1=CC=C(C(=O)O)S1 BB57-7175 [0,2,0,0,0,0|1,0,0]=3 260 B11R1.175 NC(=O)C1=CC=C(C(=O)O)S1 BB55-4851 [0,2,0,0,0,0|1,0,0]=3 261 B11R1.175 O=C(O)C1=CC=C(C(=O)O)O1 BB55-6820 [0,2,0,0,0,0|1,1,0]=4 262 B11R1.49 CCC1=C(C(=O)O)N=C(Cl)S1 BB26-0180 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.49 CCC1=C(C(=O)O)SC(C)=N1 BB12-3625 [0,2,0,0,0,0|2,0,0]=4 264 B9R1.6 O=C(O)C1=CC=CN=N1 BB58-3622 [0,0,1,1,0,0|2,0,0]=4 265 B9R1.2 OCC1=CC(Cl)=NC=C1 BB57-3750 [1,0,0,0,0,1|1,0,1]=4 266 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [1,0,0,0,0,1|1,0,0]=3 267 B9R1.13 N=C(N)CC1=CC=CS1 BB12-3709 [1,0,0,0,0,1|2,0,0]=4 268 B9R1.13 NC(=S)CC1=CC=CS1 BB57-5509 [1,0,0,0,0,1|1,1,0]=4 269 B9R1.13 O=C(O)CC1=CC=CN1 BB58-0483 [1,0,0,0,0,1|1,0,0]=3 270 B9R1.13 O=C(O)CC1=CSC=N1 BB54-4129 [1,0,0,0,0,1|2,0,0]=4 271 B9R1.13 O=C(O)CN1C=CC=C1 BB55-6532 [1,0,0,0,0,1|2,0,0]=4 272 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [0,0,0,0,0,2|2,0,0]=4 273 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 BB54-4732 [0,0,0,0,0,2|1,0,0]=3 274 B11R1.75 NC(=O)\C=C\C1=CC=C(Br)S1 BB17-2532 [0,0,0,0,0,2|1,1,0]=4 275 B11R1.75 O=C(O)\C=C\C1=CC=C(Br)S1 BB17-2524 [0,0,0,0,0,2|0,1,0]=3